karalicin

CHEBI:66140 ·resolve ·ANTIVIRAL ·EXACT SEEDED

A pentitol derivative that is 3-O-acetyl-1-deoxypentitol substituted by a 4-methoxyphenyl group at position 1. Isolated from the fermentation broth of Pseudomonas fluorescens and Pseudomonas putida, it exhibits anti-HSV-1 activity. — ChEBI

Machine-generated and unreviewed. Identity, structure and cross-references come straight from ChEBI's and CARD's own data; no curator has signed off on this record yet.

Classification

Strictly broader compounds or drug classes this molecule belongs to.

CHEBI:25235 CHEBI:25235
CHEBI:27136 CHEBI:27136
CHEBI:47622 CHEBI:47622
CHEBI:63434 CHEBI:63434

Chemical structure

Computed structure properties
Molecular formula	C14H20O6
Charge	0
Average mass	284.308 Da
Monoisotopic mass	284.12599 Da
Source	ChEBI
InChIKey	JATBUOZGJQJSGA-UHFFFAOYSA-N

SMILES

COc1ccc(CC(O)C(OC(C)=O)C(O)CO)cc1

InChI

InChI=1S/C14H20O6/c1-9(16)20-14(13(18)8-15)12(17)7-10-3-5-11(19-2)6-4-10/h3-6,12-15,17-18H,7-8H2,1-2H3

Also called

3-O-acetyl-1-deoxy-1-(4-methoxyphenyl)pentitol (EXACT_SYNONYM)— chebi
[1,2,4-trihydroxy-5-(4-methoxyphenyl)pentan-3-yl] acetate (EXACT_SYNONYM)— chebi

Cross-references

Equivalent identifiers for this same structure in other resources.

reaxys:7816467

Activity roles

Every antimicrobial role a source asserts for this compound — the unreduced evidence behind its antimicrobial_class.

CHEBI:64953 CHEBI:64953

Source concepts

Every upstream concept that resolved to this record. The merge is the product: this is what shows ChEBI and CARD are describing the same structure.

Upstream concepts merged into this record
Source	Native ID	Label	Minted CURIE	Version
CHEBI	`CHEBI:66140`	karalicin	`antibioticmech:chebi-8588964c7a`	2026-08-30

Curation history

SEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Seeded from data/raw/ inventories (CHEBI)
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories
RESEEDED_FROM_SOURCES 2026-08-30 · seed_from_sources
Re-seeded from updated data/raw/ inventories

Provenance

Seeded by scripts/seed_from_sources.py from the committed inventories in data/raw/. View the record.